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CHEBI:190041 - Retinylphosphate mannose

Default Structure
ChEBI IDCHEBI:190041
ChEBI NameRetinylphosphate mannose
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H41O9P
Net Charge0
Average Mass528.579
Monoisotopic Mass528.24882
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/COP(=O)(O)OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)C(C)(C)CCC1
InChIInChI=1S/C26H41O9P/c1-17(11-12-20-19(3)10-7-14-26(20,4)5)8-6-9-18(2)13-15-33-36(31,32)35-25-24(30)23(29)22(28)21(16-27)34-25/h6,8-9,11-13,21-25,27-30H,7,10,14-16H2,1-5H3,(H,31,32)/b9-6+,12-11+,17-8+,18-13+/t21-,22-,23+,24+,25?/m1/s1
InChIKeyBGSGEOPBGIBLBS-CIGYHBHLSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
Retinylphosphate mannose (CHEBI:190041) is a retinoid (CHEBI:26537)
IUPAC Name 
[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] [(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
Manual XrefsDatabases
4942858ChemSpider
Registry NumbersSources
CAS:55722-25-3ChemIDplus